7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one

C17H22N4O3 — CID 136566419

IUPAC7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one
SMILESCN1CC(=O)Nc2cc(C(=O)N3CCOCC3CC3CC3)cnc21
InChIInChI=1S/C17H22N4O3/c1-20-9-15(22)19-14-7-12(8-18-16(14)20)17(23)21-4-5-24-10-13(21)6-11-2-3-11/h7-8,11,13H,2-6,9-10H2,1H3,(H,19,22)
InChIKeyGMCOTFYJMCZBMF-UHFFFAOYSA-N
MW330.39 g/mol
LogP1.11
Rot. Bonds3

About 7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one

7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one (PubChem CID 136566419) has the molecular formula C17H22N4O3 and a molecular weight of 330.39 g/mol. Its IUPAC name is 7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one.

Molecular Properties

Compound Name7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one
PubChem CID136566419
Molecular FormulaC17H22N4O3
Molecular Weight330.39 g/mol
Exact Mass330.17
IUPAC Name7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one
SMILESCN1CC(=O)Nc2cc(C(=O)N3CCOCC3CC3CC3)cnc21
InChIInChI=1S/C17H22N4O3/c1-20-9-15(22)19-14-7-12(8-18-16(14)20)17(23)21-4-5-24-10-13(21)6-11-2-3-11/h7-8,11,13H,2-6,9-10H2,1H3,(H,19,22)
InChIKeyGMCOTFYJMCZBMF-UHFFFAOYSA-N
XLogP1.11
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
The IUPAC name of 7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one (CID 136566419) is 7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one.
What is the SMILES notation for 7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
The canonical SMILES for 7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one is CN1CC(=O)Nc2cc(C(=O)N3CCOCC3CC3CC3)cnc21.
What is the InChIKey of 7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
The InChIKey is GMCOTFYJMCZBMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3/c1-20-9-15(22)19-14-7-12(8-18-16(14)20)17(23)21-4-5-24-10-13(21)6-11-2-3-11/h7-8,11,13H,2-6,9-10H2,1H3,(H,19,22).
What are the key properties of 7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one has a molecular weight of 330.39 g/mol, XLogP of 1.11, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[3-(cyclopropylmethyl)morpholine-4-carbonyl]-4-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one is sourced from PubChem (CID 136566419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).